5-[5-[2-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)-6-nitro-phenoxy]pentyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[5-[2-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)-6-nitro-phenoxy]pentyl]-3-methyl-1,2-oxazole Openeye Name: 5-[5-[2-bromo-4-(4,5-dihydrooxazol-2-yl)-6-nitro-phenoxy]pentyl]-3-methyl-isoxazole CAS Name: 5-[5-[2-bromo-4-(4,5-dihydrooxazol-2-yl)-6-nitrophenoxy]pentyl]-3-methylisoxazole IUPAC Name: 5-[5-[2-bromo-4-(4,5-dihydro-1,3-oxazol-2-yl)-6-nitrophenoxy]pentyl]-3-methyl-1,2-oxazole Traditional Name: 5-[5-[2-bromo-6-nitro-4-(2-oxazolin-2-yl)phenoxy]pentyl]-3-methyl-isoxazole Formula: C18H20BrN3O5 MolecularWeight: 438.2725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Br)C3=NCCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Br)C3=NCCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H20BrN3O5/c1-12-9-14(27-21-12)5-3-2-4-7-25-17-15(19)10-13(11-16(17)22(23)24)18-20-6-8-26-18/h9-11H,2-8H2,1H3